ID: 105421
SMILES:c1(CCCCC)cc2c(c(O)c1)C1CC(C)=CC(=O)C1C(C(CCC=C(C)C)C)(O)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.652
CB1 binding score: -13.629
InChIKey:LACQSGATYGIURI-UHFFFAOYSA-N
ID: 105422
SMILES:C(CCC(C1Cc2c(OC)cc(CC=C)cc2OC1(C)C)=O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -13.348
InChIKey:QXQOWVHZMMCYAH-UHFFFAOYSA-N
ID: 105423
SMILES:c1c(O)c(CC=C(C)CCC=C(C)C)c(O)c2c1Oc1c(c(O)cc(CCCCC)c1)C=C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.603
CB1 binding score: -16.103
InChIKey:NTQAYUJLVODOEM-UHFFFAOYSA-N
ID: 105424
SMILES:C1=C(C)C(O)C(OC(c2ccc([N+](O)=O)cc2)=O)C2C1c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 496.58
CB1 binding score: -12.74
InChIKey:FGEDPYVIPWQINA-UHFFFAOYSA-O
ID: 105425
SMILES:C=C(C)C1C(c2cc(CCCCC)cc(O)c2)CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -16.993
InChIKey:UJDULBLXJFNKOT-UHFFFAOYSA-N
ID: 105426
SMILES:C(=O)(CC(C)C)c1c(O)c(CC=C(C)C)c(O)c(C2C=C(C)CCC2C(C)=C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -16.616
InChIKey:GSIGZRDHTNPMRL-UHFFFAOYSA-N
ID: 105427
SMILES:C1Oc2cc(CCCCC)cc(OCC=C(CC(=O)C=C(C)C)C)c2C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -15.467
InChIKey:DMYRVTLRYQMVEI-UHFFFAOYSA-N
ID: 105428
SMILES:c12c(C=CC(O)=O)cc(CCCCC)cc1OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -14.595
InChIKey:NSXLGROQWUOUBC-UHFFFAOYSA-N
ID: 105429
SMILES:c1c(O)c(C2C(C(C=O)=C)CCC(C)C2)c(O)cc1CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -14.074
InChIKey:JNHLFEAARYYZQN-UHFFFAOYSA-N
ID: 105430
SMILES:C(C1C(=O)C(C)=C(C)C1(OC(C(C)(C)C)=O)C)CC(=O)c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 522.682
CB1 binding score: -14.24
InChIKey:RPKXWSDGVORUOB-UHFFFAOYSA-N
ID: 105431
SMILES:C(C(CCCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)C)(OC)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.285
InChIKey:WIOLEQSDUHWOMH-UHFFFAOYSA-N
ID: 105432
SMILES:C(Cc1cc2c(c(O)c1)C1C=C(C)CC(O)C1(C)C(O)CC2C(C)=C)CC(C)=CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.598
CB1 binding score: -11.745
InChIKey:CWQDACMSNQYUGU-UHFFFAOYSA-N
ID: 105433
SMILES:CC(C1=CC(c2c(O)cc(CCCCC)cc2O)C(=O)C(OC)=C1CC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -14.286
InChIKey:VCEVNHRFIXQERP-UHFFFAOYSA-N
ID: 105434
SMILES:C(CCCc1cc(O)c(C2C(C(=C)C)CCC(C)=C2)c(C)c1)=CC=CC(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.584
CB1 binding score: -14.34
InChIKey:ORFBOKQORKKKGJ-UHFFFAOYSA-N
ID: 105435
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 105436
SMILES:C1(C)(C)Oc2cc(CCc3ccccc3)cc(O)c2C2CC(C)=CCC12
Pathway: Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids;Stilbenoids
Class: Cannabinoids;Monomeric stilbenes
MW: 348.486
CB1 binding score: -17.817
InChIKey:AAVGZFGYDPFYEH-UHFFFAOYSA-N
ID: 105437
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 105438
SMILES:C(Cc1cc(OC(=O)C)c(C2CC(=C)CCC2C(=C)C)c(O)c1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -14.724
InChIKey:SATIZAIWSJVTOH-UHFFFAOYSA-N
ID: 105439
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1=C2CC(C)(O)CC1)CC=C(Cc1ccc(O)cc1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.603
CB1 binding score: -12.318
InChIKey:VKIWTODOSGMJBE-UHFFFAOYSA-N
ID: 105440
SMILES:C12CC(O)C3(C)Oc4cc(C)cc(O)c4C1C2C(C)(C)OC3(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -12.698
InChIKey:RNLSPGYSAQGORO-UHFFFAOYSA-N
ID: 105441
SMILES:C1(C(C)=C)CC(C(=C)C)C(c2c(O)cc(CCCCC)cc2O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -17.591
InChIKey:PRXJTFYIEZDMIQ-UHFFFAOYSA-N