ID: 57541
SMILES:c1(O)c2c(cc(CCCC)c1)OC(C)(C)C1C2C(=O)C(C)=CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -14.1
InChIKey:FLBAHJHZKUPKQZ-UHFFFAOYSA-N
ID: 57542
SMILES:C(CCCCCC)CCc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -16.552
InChIKey:IQQWVNYGBXVDNU-UHFFFAOYSA-N
ID: 57543
SMILES:O1c2c(c(O)cc(C)c2)C2C3C(C)(C(Cl)CC(Cl)C3(O)C)C(CC(C)(C)O)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 429.384
CB1 binding score: -14.109
InChIKey:FFVDPBUDNANZKS-UHFFFAOYSA-N
ID: 57544
SMILES:c1(O)cc([N+](O)=O)c(O)c(C2C(C(C)=C)CCC(C)=C2)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.339
CB1 binding score: -17.859
InChIKey:LYIXUYMVOVRICB-UHFFFAOYSA-O
ID: 57545
SMILES:C(C(c1cc(O)c(C2C=C(C)CCC2(C)CO)c(O)c1)C(C)C)C(=O)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -14.882
InChIKey:BGDGHVVSYZDSMA-UHFFFAOYSA-N
ID: 57546
SMILES:C1=C(C)CCC2C1C(C)(C)Oc1c2c(C)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -16.245
InChIKey:YMYDCCNJJAMIFC-UHFFFAOYSA-N
ID: 57547
SMILES:c1(-c2c(C)cc(O)c3c2CC2C(C)(O3)CCC(C(C)(O)C)O2)cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 534.693
CB1 binding score: -15.702
InChIKey:YTJMZNXGKXSKSU-UHFFFAOYSA-N
ID: 57548
SMILES:C(CCC1(C)Oc2c(c(O)cc(CCCCC)c2)C(C)C(=O)C1)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -14.48
InChIKey:MXHXPGFNCHUYFO-UHFFFAOYSA-N
ID: 57549
SMILES:CC1=CC(=O)CC(C)(C)C1Oc1cc(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -15.737
InChIKey:QYZKQYANJXBJTN-UHFFFAOYSA-N
ID: 57550
SMILES:COc1c(C2C=C(C)CCC2C(C)=C)c(Cl)cc(OCC=C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.871
CB1 binding score: -15.613
InChIKey:DZTFQOXXGGAXAE-UHFFFAOYSA-N
ID: 57551
SMILES:o1c(CCCCC)cc2c1C1C=C(C=O)CCC1C(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -14.162
InChIKey:KYPJTPSGKJGVNL-UHFFFAOYSA-N
ID: 57552
SMILES:CCCCCc1ccc2c(c1O)C=CC(C)(CCC=C(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.055
InChIKey:YNUMDHXFQAUOGS-UHFFFAOYSA-N
ID: 57553
SMILES:C12C=C(C)CCC1C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 57554
SMILES:C12C(c3c(cc(CCCCC)cc3O)OC1(C)C)C(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -18.334
InChIKey:JRPARYVCKDQCGY-UHFFFAOYSA-N
ID: 57555
SMILES:C1C(C)C(C)(C)C(c2c(OC)cc(CCCCC)cc2OC=C(C)CCCC(O)(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.7
CB1 binding score: -13.39
InChIKey:CNCVIENYMTUXDC-UHFFFAOYSA-N
ID: 57556
SMILES:C1=C(C)CC2C(C1)C(C)(C)Oc1c(c(OC)c3c(c1C)OC(C)(C)C=C3)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 368.517
CB1 binding score: -13.171
InChIKey:DZKDAACXNXRIJV-UHFFFAOYSA-N
ID: 57557
SMILES:CC1(C)C=CCC2(C)Oc3c(c(O)cc(CCCCCC)c3)C3(C(C)(O3)C2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -15.328
InChIKey:QMVXULSPBRNZLB-UHFFFAOYSA-N
ID: 57558
SMILES:C1C(OC(=O)C)C(CCC=C(C)CCC=C(C)C)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.64
CB1 binding score: -16.124
InChIKey:YFZBNWBFMPQXSU-UHFFFAOYSA-N
ID: 57559
SMILES:C(CCCC)Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(CO)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -18.264
InChIKey:JSQZQNWIVUSPJH-UHFFFAOYSA-N
ID: 57560
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(CO)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 57561
SMILES:CC1=CCCC(=C)C(O)CC(C)=CCC1c1c(OC(C)=O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -15.929
InChIKey:HXEAFUMHXCKKOE-UHFFFAOYSA-N