ID: 67999
SMILES:C1(COC(=O)C)=CC2c3c(OC)cc(CCCCC)cc3OC(C)(C)C2CC1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -15.12
InChIKey:CHOZPXYKSABNAW-UHFFFAOYSA-N
ID: 68000
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2CC(CO)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.832
InChIKey:LOUSQMWLMDHRIK-UHFFFAOYSA-N
ID: 68001
SMILES:C1(C)CC2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.32
InChIKey:WWYMYGIVLCKTBL-UHFFFAOYSA-N
ID: 68002
SMILES:C1CC(C)(C)OC(CC(=CCc2cc(OC)cc(C)c2O)C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -15.922
InChIKey:LEKNHYCOTLEUBU-UHFFFAOYSA-N
ID: 68003
SMILES:C(=C)(C1CCC(C)(O)C(Cc2c(O)cc(C)c(O)c2)C1(C)CCC(O)=O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -17.671
InChIKey:GRJSHEJWYPEDDD-UHFFFAOYSA-N
ID: 68004
SMILES:c1(C(CCCCCCCCCCCCC)C)c(O)c2c(c(C=O)c1O)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 498.748
CB1 binding score: -15.929
InChIKey:GOUBTDCUQCHGOZ-UHFFFAOYSA-N
ID: 68005
SMILES:C1(C)C(c2c(O)cc(CCCC)cc2O)(CCC2OC2(C)CCC=C(C)C)OC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.575
CB1 binding score: -14.516
InChIKey:LKBTUJIPLJDRNS-UHFFFAOYSA-N
ID: 68006
SMILES:C(C)(CCCC1(C)Oc2c(C)cc(Oc3cc(C)cc(O)c3C(CCl)C2)cc1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.989
CB1 binding score: -13.804
InChIKey:UYVDRGBGTAMNEU-UHFFFAOYSA-N
ID: 68007
SMILES:C12(CC3=C(C)CCC3C(C)(C)O1)Oc1c(c(OC)cc(CCC(OC(C)=O)C)c1)C2=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.525
CB1 binding score: -13.965
InChIKey:BOJSQWKLXHJHDL-UHFFFAOYSA-N
ID: 68008
SMILES:CC1=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 68009
SMILES:C1C2(C)C(CCC3C2c2c(cc(CCCCC)cc2O)O3)C(C)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -16.882
InChIKey:YSVYPLBKCMVPPI-UHFFFAOYSA-N
ID: 68010
SMILES:CC1C2C(C)(CCC3C(C)(C)C3C2)Oc2c1c(O)cc(CCCCC)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -13.552
InChIKey:MSKLNXDZDIRUNE-UHFFFAOYSA-N
ID: 68011
SMILES:O1c2cc(CCCCC)cc(O)c2C2C3C(C)(O)CCC13C(C)C(O)CC(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.574
CB1 binding score: -16.055
InChIKey:QDERTBHUUIZHSH-UHFFFAOYSA-N
ID: 68012
SMILES:C1C2C3CC1(C)Oc1c3c(cc(CCCC)c1)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -15.225
InChIKey:DJWVPFRQZHZYNN-UHFFFAOYSA-N
ID: 68013
SMILES:CC1(C)Oc2c(c(O)cc(CCCCCO)c2)C2C3=C(C(=O)OC3)CCC(C)CCC=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 496.688
CB1 binding score: -13.264
InChIKey:KKDFWXFYTKHEAX-UHFFFAOYSA-N
ID: 68014
SMILES:c1(C)c(CC=C(C)C)c(CCC(C2CCC(C)=C(C)C2)(C)O)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -14.93
InChIKey:DZQYFDODTOKMLL-UHFFFAOYSA-N
ID: 68015
SMILES:C123c4c(cc(CCCCC)cc4O)OC(C)(C4=CCC(C)(C)C14)OC(C)(CC2)C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -15.087
InChIKey:PZRHFOHYBXSHIR-UHFFFAOYSA-N
ID: 68016
SMILES:C1(Br)C(C)(C)Oc2c(c(O)cc(CCCCC)c2)C=C1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 355.272
CB1 binding score: -13.113
InChIKey:BXXXPEVJHYCRRO-UHFFFAOYSA-N
ID: 68017
SMILES:C(c1c2c(c3c(c1)OC(C)(C)C=C3)OC(C)(C)C1CCC(C)CC21)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -14.936
InChIKey:KFJCLEQBYWFUIY-UHFFFAOYSA-N
ID: 68018
SMILES:c1(CC)cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -18.786
InChIKey:YURJBXYTSFIOOT-UHFFFAOYSA-N
ID: 68019
SMILES:C1(C)(C)Oc2cc(O)cc(CCCCC)c2-c2c(O)cc(C3C(C(C)C)CCC(C)=C3)c(O)c2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.645
CB1 binding score: -15.816
InChIKey:RWCDTEMGUIQDRV-UHFFFAOYSA-N