ID: 57982
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C(O)C2O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 280.364
CB1 binding score: -18.858
InChIKey:FCEJYUOQVZGCIK-UHFFFAOYSA-N
ID: 57983
SMILES:O1c2cc(CCCCC)cc(O)c2C(=O)C1(O)C(C=C(CCC=C(C)C)C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -15.929
InChIKey:UCKWPZIQJYLROX-UHFFFAOYSA-N
ID: 57984
SMILES:CC(C)=CCCC(C)=CC1OC2(c3c(cc(CCCCC)cc3O)O2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -13.499
InChIKey:HETQULBDTYPWKV-UHFFFAOYSA-N
ID: 57985
SMILES:c1(O)cc(O)cc2c1OC(C)(C)C1CCC(CO)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.332
CB1 binding score: -19.71
InChIKey:KAQLLXIMGJNENQ-UHFFFAOYSA-N
ID: 57986
SMILES:c12c(O)cc(C(=C)CCCCC)cc1OC(C)(C)C1C2C=C(COCC(O)CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.585
CB1 binding score: -16.87
InChIKey:ABILFTRIRDOAQY-UHFFFAOYSA-N
ID: 57987
SMILES:O(c1cc(CC(O)C)cc2c1OC(C)(C)C1C2C=C(C(O)=O)CC1)C=Cc1ccccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.532
CB1 binding score: -14.028
InChIKey:KMFPWUPJBLUSMY-UHFFFAOYSA-N
ID: 57988
SMILES:CC1(C)Oc2cc(C)c(CC=C(C)C)c(O)c2C2C1CC(C(=O)OC)C(C=O)CC=C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.58
CB1 binding score: -16.181
InChIKey:LQOOHVBSYDLMDF-UHFFFAOYSA-N
ID: 57989
SMILES:C(C)(=CCc1c(O)c(C2C(C(CO)=C)CCC(C)=C2)c(O)cc1)C=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -14.349
InChIKey:UYENJHDXJFXYCW-UHFFFAOYSA-N
ID: 57990
SMILES:C(CCC=C)c1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1CC=C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.691
CB1 binding score: -13.897
InChIKey:JHMQDKWFFXNMDC-UHFFFAOYSA-N
ID: 57991
SMILES:Oc1c2c(cc(CCCCC)c1)OC(CO)(CCC=C(C)C)C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -16.323
InChIKey:LBAUSDDYRVZTSH-UHFFFAOYSA-N
ID: 57992
SMILES:C1CC23COC(C2C(=O)c2c(cc(CCCCC)cc2O)O3)C=C(C)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -14.56
InChIKey:OBZJABXLAZAQSB-UHFFFAOYSA-N
ID: 57993
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 57994
SMILES:C1(C)=CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 57995
SMILES:c1(CCCC)cc2c(c(O)c1)OC(C)(C)C1C2C=C(C(=O)O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -16.284
InChIKey:HPXJNMKPDSRFCF-UHFFFAOYSA-N
ID: 57996
SMILES:C1(c2c(CCCCC)cc(O)cc2O)OC(C=C(C)CCC=C(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.155
InChIKey:NHTOQPZJYBLMOG-UHFFFAOYSA-N
ID: 57997
SMILES:C12c3ccc(C)cc3OC(C)(C)C1CCC=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 228.335
CB1 binding score: -12.145
InChIKey:DCSHYULCJVZHBI-UHFFFAOYSA-N
ID: 57998
SMILES:C1(Cc2c(O)cc(CCCCC)cc2O)C(C)(C)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -16.968
InChIKey:CKKNQYUUWIRDPZ-UHFFFAOYSA-N
ID: 57999
SMILES:C12(C)CCC(C)(C)CC1=Cc1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.663
InChIKey:UGJDJOXVGIFERS-UHFFFAOYSA-N
ID: 58000
SMILES:CC1CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 58001
SMILES:C(CC=C(C)C)C(=C)C=CCC1(C)C(Cc2c(O)c(C)c(C)c(O)c2)CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.626
CB1 binding score: -14.58
InChIKey:KEDWONCJGALXCB-UHFFFAOYSA-N
ID: 58002
SMILES:CC(=C)C1C(c2c(O)cc(CCCCC)c(C=O)c2O)CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.267
InChIKey:CIGPHVYZNRXFFH-UHFFFAOYSA-N