25-ANHYDROCIMIGENOL 3-O-.ALPHA.-L-ARABINOSIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C35H54O8
Molecular Weight	602.7985
Optical Activity	UNSPECIFIED
Defined Stereocenters	17 / 17
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 25-ANHYDROCIMIGENOL 3-O-.ALPHA.-L-ARABINOSIDE

Structure Search

SMILES

C[C@@H]1C[C@H]2O[C@@]3(O[C@@H]2C(C)=C)[C@H](O)[C@@]4(C)[C@@H]5CC[C@@H]6[C@]7(C[C@@]57CC[C@]4(C)[C@@H]13)CC[C@H](O[C@@H]8OC[C@H](O)[C@H](O)[C@H]8O)C6(C)C

InChI

InChIKey=CVBALRXHSITZGC-KVIXFTAMSA-N

InChI=1S/C35H54O8/c1-17(2)26-20-14-18(3)27-31(6)12-13-34-16-33(34)11-10-23(41-28-25(38)24(37)19(36)15-40-28)30(4,5)21(33)8-9-22(34)32(31,7)29(39)35(27,42-20)43-26/h18-29,36-39H,1,8-16H2,2-7H3/t18-,19+,20-,21+,22+,23+,24+,25-,26-,27-,28+,29-,31-,32-,33-,34+,35+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C35H54O8
Molecular Weight	602.7985
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	17 / 17
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 21:11:53 GMT 2025` Edited by `admin` on `Mon Mar 31 21:11:53 GMT 2025`
Record UNII	HKA5772VF6
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

25-ANHYDROCIMIGENOL 3-O-.ALPHA.-L-ARABINOSIDE

Common Name

English

.ALPHA.-L-ARABINOPYRANOSIDE, (3.BETA.,15.ALPHA.,16.ALPHA.,23R,24R)-16,23:16,24-DIEPOXY-15-HYDROXY-9,19-CYCLOLANOST-25-EN-3-YL

Preferred Name

English

Code System Code Type Description

CAS

473463-19-3

Created by admin on Mon Mar 31 21:11:53 GMT 2025 , Edited by admin on Mon Mar 31 21:11:53 GMT 2025

PRIMARY

FDA UNII

HKA5772VF6

Created by admin on Mon Mar 31 21:11:53 GMT 2025 , Edited by admin on Mon Mar 31 21:11:53 GMT 2025

PRIMARY

PUBCHEM

70698285

Created by admin on Mon Mar 31 21:11:53 GMT 2025 , Edited by admin on Mon Mar 31 21:11:53 GMT 2025

PRIMARY

Related Record Type Details


					K73E24S6X9

BLACK COHOSH

PARENT -> CONSTITUENT ALWAYS PRESENT