MACRANTHOIDIN B

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C65H106O32
Molecular Weight	1399.5179
Optical Activity	UNSPECIFIED
Defined Stereocenters	38 / 38
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@@H](O)CO[C@H]2O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C6[C@@H]7CC(C)(C)CC[C@@]7(CC[C@@]56C)C(=O)O[C@@H]8O[C@H](CO[C@@H]9O[C@H](CO)[C@@H](O)[C@H](O)[C@H]9O)[C@@H](O)[C@H](O)[C@H]8O)[C@]3(C)CO)[C@H](O)[C@H](O[C@@H]%10O[C@H](CO)[C@@H](O[C@@H]%11O[C@H](CO)[C@@H](O)[C@H](O)[C@H]%11O)[C@H](O)[C@H]%10O)[C@H]1O

InChI

InChIKey=RKINZCVTEPSBCI-ZBXZRPIVSA-N

InChI=1S/C65H106O32/c1-25-36(71)51(95-55-48(83)44(79)50(31(21-68)91-55)94-54-46(81)42(77)39(74)30(20-67)90-54)49(84)57(88-25)96-52-37(72)28(70)22-86-58(52)93-35-11-12-61(4)33(62(35,5)24-69)10-13-64(7)34(61)9-8-26-27-18-60(2,3)14-16-65(27,17-15-63(26,64)6)59(85)97-56-47(82)43(78)40(75)32(92-56)23-87-53-45(80)41(76)38(73)29(19-66)89-53/h8,25,27-58,66-84H,9-24H2,1-7H3/t25-,27-,28-,29+,30+,31+,32+,33+,34+,35-,36-,37-,38+,39+,40+,41-,42-,43-,44+,45+,46+,47+,48+,49+,50+,51+,52+,53+,54-,55-,56-,57-,58-,61-,62-,63+,64+,65-/m0/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

3-((O-.BETA.-D-GLUCOPYRANOSYL-(1->4)-O-.BETA.-D-GLUCOPYRANOSYL-(1->3)-O-6-DEOXY-.ALPHA.-L-MANNOPYRANOSYL-(1->2)-.ALPHA.-L-ARABINOPYRANOSYL)OXY)-23-HYDROXY-OLEAN-12-EN-28-OIC ACID 6-O-.BETA.-D-GLUCOPYRANOSYL-.BETA.-D-GLUCOPYRANOSYL ESTER, (3.BETA.,4.ALPHA

Preferred Name

English

MACRANTHOIDIN B

Common Name

English

Code System Code Type Description

PUBCHEM

71307567

Created by admin on Mon Mar 31 23:21:21 GMT 2025 , Edited by admin on Mon Mar 31 23:21:21 GMT 2025

PRIMARY

FDA UNII

9S74S1AGHC

Created by admin on Mon Mar 31 23:21:21 GMT 2025 , Edited by admin on Mon Mar 31 23:21:21 GMT 2025

PRIMARY

CAS

136849-88-2

Created by admin on Mon Mar 31 23:21:21 GMT 2025 , Edited by admin on Mon Mar 31 23:21:21 GMT 2025

PRIMARY

SUBSTANCE RECORD


					9S74S1AGHC

MACRANTHOIDIN B