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1-(6-[3]-ladderanehexanyl)-2-(8-[3]-ladderaneoctanyl)-sn-glycero-3-phosphocholine

Properties

Image

Occurences in reactions

MNX_ID

MNXM24540

	#reac
in my sandbox	0
in MNXref (generic)	0
in models (compartimentalized)	0

formula

C₄₆H₈₀NO₆P

charge

mass

773.57233

reference

chebi:136374

InChIKey

QQEHCXNZXKPTRM-NRVURWKZSA-N

InChI

InChI=1S/C46H80NO6P/c1-47(2,3)24-27-52-54(48,49)53-31-34(30-50-25-12-9-7-11-15-33-17-19-40-42(29-33)46-38-23-21-36(38)44(40)46)51-26-13-8-5-4-6-10-14-32-16-18-39-41(28-32)45-37-22-20-35(37)43(39)45/h32-46H,4-31H2,1-3H3/t32?,33?,34-,35?,36?,37?,38?,39?,40?,41?,42?,43?,44?,45?,46?/m1/s1

SMILES

C[N+](C)(C)CCOP(=O)([O-])OC[C@@H](COCCCCCCC1CCC2C(C1)C1C3CCC3C21)OCCCCCCCCC1CCC2C(C1)C1C3CCC3C21

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:136374 chebi:136374	1-(6-[3]-ladderanehexanyl)-2-(8-[3]-ladderaneoctanyl)-sn-glycero-3-phosphocholine (2R)-3-{[6-(tetracyclo[6.4.0.0(2,7).0(3,6)]dodecan-10-yl)hexyl]oxy}-2-{[8-(tetracyclo[6.4.0.0(2,7).0(3,6)]dodecan-10-yl)octyl]oxy}propyl 2-(trimethylazaniumyl)ethyl phosphate
lipidmaps:LMGP01040090 lipidmapsM:LMGP01040090	1-(6-[3]-ladderane-hexanyl)-2-(8-[3]-ladderane-octanyl)-sn-glycerophosphocholine PC dO-38:8