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Ingredients

Manassantin a

C42H52O11

Entity Type
Ingredients
Relation Groups
2
Relation Preview
6

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name
Manassantin a
Molecular Formula
C42H52O11
Molecular Weight
No data
Canonical SMILES
CC1C(C(OC1C2=CC(=C(C=C2)OC(C)C(C3=CC(=C(C=C3)OC)OC)O)OC)C4=CC(=C(C=C4)OC(C)C(C5=CC(=C(C=C5)OC)OC)O)OC)C
Isomeric SMILES
C[C@@H]1[C@H]([C@H](O[C@@H]1C2=CC(=C(C=C2)O[C@H](C)[C@@H](C3=CC(=C(C=C3)OC)OC)O)OC)C4=CC(=C(C=C4)O[C@H](C)[C@@H](C5=CC(=C(C=C5)OC)OC)O)OC)C
InChI
InChI=1S/C42H52O11/c1-23-24(2)42(30-14-18-34(38(22-30)50-10)52-26(4)40(44)28-12-16-32(46-6)36(20-28)48-8)53-41(23)29-13-17-33(37(21-29)49-9)51-25(3)39(43)27-11-15-31(45-5)35(19-27)47-7/h11-26,39-44H,1-10H3/t23-,24-,25-,26-,39+,40+,41+,42+/m1/s1
Oral Bioavailability
No data
Drug Likeness
0.117
DL Score
No data
Caco-2 Permeability
No data
ALogP
No data
Bioavailability Score
No data

Identifiers

InChI Key
No data
PubChem CID
No data

Description and Extensions

Toxicity Information
No data
Related

Direct relations and traceable candidates grouped by relation type.

Source Herbs

herb ingredient4 Herbs
02
松节
Song Jie / Lignum Pini Tabulaeformis Nodi; Lignum Pini Massonianae Nodi; Ligum Pini Densoflorae Nodi; Lignum Pini Yunnaensis Nodi
Song JieLignum Pini Tabulaeformis Nodi; Lignum Pini Massonianae Nodi; Ligum Pini Densoflorae Nodi; Lignum Pini Yunnaensis Nodi
04
鱼腥草
Yu Xing Cao / Herba Houttuyniae; Houttuyniae Herba
Yu Xing CaoHerba Houttuyniae; Houttuyniae Herba