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Details

Stereochemistry ABSOLUTE
Molecular Formula C48H78O19
Molecular Weight 959.1215
Optical Activity UNSPECIFIED
Defined Stereocenters 27 / 27
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ASIATICOSIDE

SMILES

[H][C@@]8(O[C@@H]1[C@@H](CO)O[C@@H](OC[C@H]2O[C@@H](OC(=O)[C@]34CC[C@@H](C)[C@H](C)[C@@]3([H])C5=CC[C@]6([H])[C@@]7(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)[C@]7([H])CC[C@@]6(C)[C@]5(C)CC4)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H]1O)O[C@@H](C)[C@H](O)[C@@H](O)[C@H]8O

InChI

InChIKey=WYQVAPGDARQUBT-FGWHUCSPSA-N
InChI=1S/C48H78O19/c1-20-10-13-48(15-14-46(6)23(29(48)21(20)2)8-9-28-44(4)16-24(51)39(60)45(5,19-50)27(44)11-12-47(28,46)7)43(61)67-42-36(58)33(55)31(53)26(65-42)18-62-40-37(59)34(56)38(25(17-49)64-40)66-41-35(57)32(54)30(52)22(3)63-41/h8,20-22,24-42,49-60H,9-19H2,1-7H3/t20-,21+,22+,24-,25-,26-,27-,28-,29+,30+,31-,32-,33+,34-,35-,36-,37-,38-,39+,40-,41+,42+,44+,45+,46-,47-,48+/m1/s1

HIDE SMILES / InChI

Molecular Formula C48H78O19
Molecular Weight 959.1215
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 27 / 27
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 01:11:44 UTC 2023
Edited
by admin
on Sat Dec 16 01:11:44 UTC 2023
Record UNII
PKO39VY215
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ASIATICOSIDE
INCI   MI   USP-RS   WHO-DD  
INCI  
Official Name English
(2.ALPHA.,3.BETA.,4.ALPHA.)-2,3,23-TRIHYDROXYURS-12-EN-28-OIC ACID O-6-DEOXY-.ALPHA.-L-MANNOPYRANOSYL-(1->4)-O-.BETA.-D-GLUCOPYRANOSYL-(1->6)-O-.BETA.-D-GLUCOPYRANOSYL ESTER
Common Name English
CENTELASE
Common Name English
MADECASSOL
Common Name English
NSC-36002
Code English
ASIATICOSIDE [USP-RS]
Common Name English
Asiaticoside [WHO-DD]
Common Name English
ASIATICOSIDE [INCI]
Common Name English
ASIATICOSIDE [MI]
Common Name English
CENTELASE DERMATOLOGICO
Common Name English
URS-12-EN-28-OIC ACID, 2,3,23-TRIHYDROXY-, O-6-DEOXY-.ALPHA.-L-MANNOPYRANOSYL-(1->4)-O-.BETA.-D-GLUCOPYRANOSYL-(1->6)-.BETA.-D-GLUCOPYRANOSYL ESTER, (2.ALPHA.,3.BETA.,4.ALPHA.)-
Common Name English
BA-2742
Code English
NSC-166062
Code English
EMDECASSOL
Common Name English
ASIATICOSID
Common Name English
ASIATICOSIDE (CONSTITUENT OF CENTELLA ASIATICA) [DSC]
Common Name English
Code System Code Type Description
NSC
166062
Created by admin on Sat Dec 16 01:11:44 UTC 2023 , Edited by admin on Sat Dec 16 01:11:44 UTC 2023
PRIMARY
RXCUI
18405
Created by admin on Sat Dec 16 01:11:44 UTC 2023 , Edited by admin on Sat Dec 16 01:11:44 UTC 2023
PRIMARY RxNorm
CAS
16830-15-2
Created by admin on Sat Dec 16 01:11:44 UTC 2023 , Edited by admin on Sat Dec 16 01:11:44 UTC 2023
PRIMARY
NCI_THESAURUS
C63665
Created by admin on Sat Dec 16 01:11:44 UTC 2023 , Edited by admin on Sat Dec 16 01:11:44 UTC 2023
PRIMARY
EPA CompTox
DTXSID30937476
Created by admin on Sat Dec 16 01:11:44 UTC 2023 , Edited by admin on Sat Dec 16 01:11:44 UTC 2023
PRIMARY
RS_ITEM_NUM
1043331
Created by admin on Sat Dec 16 01:11:44 UTC 2023 , Edited by admin on Sat Dec 16 01:11:44 UTC 2023
PRIMARY
MERCK INDEX
m2092
Created by admin on Sat Dec 16 01:11:44 UTC 2023 , Edited by admin on Sat Dec 16 01:11:44 UTC 2023
PRIMARY Merck Index
DAILYMED
PKO39VY215
Created by admin on Sat Dec 16 01:11:44 UTC 2023 , Edited by admin on Sat Dec 16 01:11:44 UTC 2023
PRIMARY
EVMPD
SUB12949MIG
Created by admin on Sat Dec 16 01:11:44 UTC 2023 , Edited by admin on Sat Dec 16 01:11:44 UTC 2023
PRIMARY
DRUG BANK
DB14081
Created by admin on Sat Dec 16 01:11:44 UTC 2023 , Edited by admin on Sat Dec 16 01:11:44 UTC 2023
PRIMARY
PUBCHEM
11954171
Created by admin on Sat Dec 16 01:11:44 UTC 2023 , Edited by admin on Sat Dec 16 01:11:44 UTC 2023
PRIMARY
SMS_ID
100000077438
Created by admin on Sat Dec 16 01:11:44 UTC 2023 , Edited by admin on Sat Dec 16 01:11:44 UTC 2023
PRIMARY
MESH
C004446
Created by admin on Sat Dec 16 01:11:44 UTC 2023 , Edited by admin on Sat Dec 16 01:11:44 UTC 2023
PRIMARY
FDA UNII
PKO39VY215
Created by admin on Sat Dec 16 01:11:44 UTC 2023 , Edited by admin on Sat Dec 16 01:11:44 UTC 2023
PRIMARY
ECHA (EC/EINECS)
240-851-7
Created by admin on Sat Dec 16 01:11:44 UTC 2023 , Edited by admin on Sat Dec 16 01:11:44 UTC 2023
PRIMARY
NSC
36002
Created by admin on Sat Dec 16 01:11:44 UTC 2023 , Edited by admin on Sat Dec 16 01:11:44 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> CONSTITUENT ALWAYS PRESENT
Constituent of Centella asiatica aerial parts.