Xanthomegnin

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C30H22O12
Molecular Weight	574.4885
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC1=C(C(=O)C2=C(C=C3C[C@@H](C)OC(=O)C3=C2O)C1=O)C4=C(OC)C(=O)C5=C(C4=O)C(O)=C6C(=O)O[C@H](C)CC6=C5

InChI

InChIKey=WICHONPZVIYWIJ-NXEZZACHSA-N

InChI=1S/C30H22O12/c1-9-5-11-7-13-17(23(33)15(11)29(37)41-9)25(35)19(27(39-3)21(13)31)20-26(36)18-14(22(32)28(20)40-4)8-12-6-10(2)42-30(38)16(12)24(18)34/h7-10,33-34H,5-6H2,1-4H3/t9-,10-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C30H22O12
Molecular Weight	574.4885
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:21:27 GMT 2025` Edited by `admin` on `Mon Mar 31 22:21:27 GMT 2025`
Record UNII	E4QHA2B8K4
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Xanthomegnin

Common Name

English

NSC-264720

Preferred Name

English

[8,8?-Bi-1H-naphtho[2,3-c]pyran]-1,1?,6,6?,9,9?-hexone, 3,3?,4,4?-tetrahydro-10,10?-dihydroxy-7,7?-dimethoxy-3,3?-dimethyl-, [R-(R*,R*)]-

Systematic Name

English

(3R,3?R)-3,3?,4,4?-Tetrahydro-10,10?-dihydroxy-7,7?-dimethoxy-3,3?-dimethyl[8,8?-bi-1H-naphtho[2,3-c]pyran]-1,1?,6,6?,9,9?-hexone

Systematic Name

English

[8,8?-Bi-1H-naphtho[2,3-c]pyran]-1,1?,6,6?,9,9?-hexone, 3,3?,4,4?-tetrahydro-10,10?-dihydroxy-7,7?-dimethoxy-3,3?-dimethyl-, (3R,3?R)-

Systematic Name

English

Xanthomegnine

Common Name

English

(3R)-10-hydroxy-8-[(3R)-10-hydroxy-7-methoxy-3-methyl-1,6,9-trioxo-1H,3H,4H,6H,9H-naphtho[2,3-c]pyran-8-yl]-7-methoxy-3-methyl-1H,3H,4H,6H,9H-naphtho[2,3-c]pyran-1,6,9-trione

Systematic Name

English

Code System Code Type Description

CAS

1685-91-2