BIS-1-(8-(1-HYDROXYETHYL)DEUTEROPORPHYRIN-3-YL)ETHYL ETHER

Investigational

Details

Stereochemistry	UNKNOWN
Molecular Formula	C68H74N8O11
Molecular Weight	1179.3622
Optical Activity	UNSPECIFIED
Defined Stereocenters	0 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of BIS-1-(8-(1-HYDROXYETHYL)DEUTEROPORPHYRIN-3-YL)ETHYL ETHER

Structure Search

SMILES

CC(O)C1=C(C)C2=CC3=NC(=CC4=C(CCC(O)=O)C(C)=C(N4)C=C5N=C(C=C1N2)C(C)=C5C(C)OC(C)C6=C7NC(C=C8N=C(C=C9NC(=CC%10=NC(=C7)C(C)=C%10C(C)O)C(C)=C9CCC(O)=O)C(CCC(O)=O)=C8C)=C6C)C(CCC(O)=O)=C3C

InChI

InChIKey=VAYJWFGRGMQINH-STKOUIOXSA-N

InChI=1S/C68H74N8O11/c1-29-41(13-17-61(79)80)53-28-56-44(16-20-64(85)86)32(4)48(72-56)24-59-68(36(8)52(76-59)25-58-65(37(9)77)33(5)49(73-58)21-45(29)69-53)40(12)87-39(11)67-35(7)50-22-46-30(2)42(14-18-62(81)82)54(70-46)27-55-43(15-19-63(83)84)31(3)47(71-55)23-57-66(38(10)78)34(6)51(74-57)26-60(67)75-50/h21-28,37-40,71-73,75,77-78H,13-20H2,1-12H3,(H,79,80)(H,81,82)(H,83,84)(H,85,86)/b45-21-,46-22-,47-23-,48-24-,49-21-,50-22-,51-26-,52-25-,53-28-,54-27-,55-27-,56-28-,57-23-,58-25-,59-24-,60-26-

HIDE SMILES / InChI

Molecular Formula	C68H72N8O11
Molecular Weight	1177.3463
Charge	0
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	0 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 16:33:58 UTC 2023` Edited by `admin` on `Fri Dec 15 16:33:58 UTC 2023`
Record UNII	625J2HS54G
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BIS-1-(8-(1-HYDROXYETHYL)DEUTEROPORPHYRIN-3-YL)ETHYL ETHER

Common Name

English

DIHEMATOPORPHYRIN ETHER

Common Name

English

Code System Code Type Description

RXCUI

23066