CHAETOCHROMIN C

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C29H24O10
Molecular Weight	532.4949
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0
Stereo Comments	AXIAL, S

SHOW SMILES / InChI

Structure Search

SMILES

C[C@@H]1CC(=O)C2=C(O1)C=C3C(C(O)=CC(O)=C3C4=C5C=C6O[C@H](C)[C@@H](C)C(=O)C6=C(O)C5=C(O)C=C4O)=C2O

InChI

InChIKey=ZHECJFNKDQXHIW-GMTAPVOTSA-N

InChI=1S/C29H24O10/c1-9-4-14(30)25-19(38-9)5-12-21(15(31)7-17(33)23(12)28(25)36)22-13-6-20-26(27(35)10(2)11(3)39-20)29(37)24(13)18(34)8-16(22)32/h5-11,31-34,36-37H,4H2,1-3H3/t9-,10-,11-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C29H24O10
Molecular Weight	532.4949
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 15:04:41 GMT 2023` Edited by `admin` on `Sat Dec 16 15:04:41 GMT 2023`
Record UNII	IXY515E9BM
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CHAETOCHROMIN C

Common Name

English

(9,9'-BI-4H-NAPHTHO(2,3-B)PYRAN)-4,4'-DIONE, 2,2',3,3'-TETRAHYDRO-5,5',6,6',8,8'-HEXAHYDROXY-2,2',3-TRIMETHYL-, STEREOISOMER

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID901104236

Created by admin on Sat Dec 16 15:04:42 GMT 2023 , Edited by admin on Sat Dec 16 15:04:42 GMT 2023

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CAS

108906-68-9

Created by admin on Sat Dec 16 15:04:42 GMT 2023 , Edited by admin on Sat Dec 16 15:04:42 GMT 2023

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FDA UNII

IXY515E9BM

Created by admin on Sat Dec 16 15:04:42 GMT 2023 , Edited by admin on Sat Dec 16 15:04:42 GMT 2023

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PUBCHEM

134687596

Created by admin on Sat Dec 16 15:04:42 GMT 2023 , Edited by admin on Sat Dec 16 15:04:42 GMT 2023

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