CARATUBERSIDE A

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C34H56O12
Molecular Weight	656.8012
Optical Activity	UNSPECIFIED
Defined Stereocenters	18 / 18
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CO[C@@H]1[C@@H](O)[C@H](O[C@H]2CC[C@@]3(C)[C@@H](CC[C@@H]4[C@@H]3CC[C@]5(C)[C@H](CC[C@]45O)C(C)=O)C2)O[C@H](C)[C@H]1O[C@@H]6O[C@H](CO)[C@H](O)[C@H](O)[C@H]6O

InChI

InChIKey=WXLJRYSLYQBMGF-RUFGMRSTSA-N

InChI=1S/C34H56O12/c1-16(36)20-10-13-34(41)22-7-6-18-14-19(8-11-32(18,3)21(22)9-12-33(20,34)4)44-31-27(40)29(42-5)28(17(2)43-31)46-30-26(39)25(38)24(37)23(15-35)45-30/h17-31,35,37-41H,6-15H2,1-5H3/t17-,18+,19+,20-,21+,22-,23-,24+,25+,26-,27-,28-,29-,30+,31+,32+,33-,34+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C34H56O12
Molecular Weight	656.8012
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	18 / 18
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 16:50:52 GMT 2025` Edited by `admin` on `Tue Apr 01 16:50:52 GMT 2025`
Record UNII	46K1O86XNH
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

PREGNAN-20-ONE, 3-((6-DEOXY-4-O-.BETA.-D-GLUCOPYRANOSYL-3-O-METHYL-.BETA.-D-GALACTOPYRANOSYL)OXY)-14-HYDROXY-, (3.BETA.,14.BETA.)-

Preferred Name

English

CARATUBERSIDE A

Common Name

English

Code System Code Type Description

CAS

119767-17-8

Created by admin on Tue Apr 01 16:50:52 GMT 2025 , Edited by admin on Tue Apr 01 16:50:52 GMT 2025

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FDA UNII

46K1O86XNH

Created by admin on Tue Apr 01 16:50:52 GMT 2025 , Edited by admin on Tue Apr 01 16:50:52 GMT 2025

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EPA CompTox

DTXSID20923106

Created by admin on Tue Apr 01 16:50:52 GMT 2025 , Edited by admin on Tue Apr 01 16:50:52 GMT 2025

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PUBCHEM

138393966

Created by admin on Tue Apr 01 16:50:52 GMT 2025 , Edited by admin on Tue Apr 01 16:50:52 GMT 2025

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