ID: 126631
SMILES:Oc1cc(CCCCC)cc2c1C1C(C(=C)C)CCC(C)=C1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -17.644
InChIKey:IEERHDNDIMSELQ-UHFFFAOYSA-N
ID: 126632
SMILES:C1C(C(C)=C)Oc2cc(CCCCC)cc(O)c2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -17.505
InChIKey:SMUBIOWKZIEXPK-UHFFFAOYSA-N
ID: 126633
SMILES:Nc1c(C)cc(O)c(C2C(C(C)=C)CCC(C)=C2)c1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 273.376
CB1 binding score: -16.041
InChIKey:JBCQKITWASMEPP-UHFFFAOYSA-N
ID: 126634
SMILES:C1(C(C)=C)CC(O)C(C)=CC1c1c(O)cc(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.108
InChIKey:PPZWAHLWZVOCDJ-UHFFFAOYSA-N
ID: 126635
SMILES:c1(O)cc(O)c(C)cc1C1C=C(C)CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -17.32
InChIKey:PAUXQOYPCTXHFI-UHFFFAOYSA-N
ID: 126636
SMILES:c12c(cc(CCCCC)cc1OC)OC(C)(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.393
CB1 binding score: -18.311
InChIKey:DKJVHSOAQAXREU-UHFFFAOYSA-N
ID: 126637
SMILES:C1(c2ccc(O)cc2)Oc2cc(CCCCC)cc(O)c2C2C1C(C)(OC(=O)C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.537
CB1 binding score: -12.989
InChIKey:PEXBVWXJVILACA-UHFFFAOYSA-N
ID: 126638
SMILES:C1(C)(C)C2CCC(CCCC(C)C)(C)Oc3cc(C)cc(O)c3C2C=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -16.278
InChIKey:HISDREOGWDBNRT-UHFFFAOYSA-N
ID: 126639
SMILES:C1(O)C(C)(C)C2(O)Cc3c(O)cc(CCCCC)cc3OC(C)(C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -15.411
InChIKey:YHUQPOWXENOVEF-UHFFFAOYSA-N
ID: 126640
SMILES:C1CC(C)=CC(c2c(O)cc(CCC)cc2O)C1C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -20.128
InChIKey:YOJPFISTURZHJT-UHFFFAOYSA-N
ID: 126641
SMILES:C(Cc1ccc(O)c2c1OC(C)(C)C1CCC(=C)CC12)C(C)(C)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.195
InChIKey:TWWNAEBWDHJOCY-UHFFFAOYSA-N
ID: 126642
SMILES:c1(O)cc(CCCCC)cc2c1C1C(C(C)(O)CCC1C(C)=C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.142
InChIKey:RBEAVAMWZAJWOI-UHFFFAOYSA-N
ID: 126643
SMILES:C1(C)=CC2c3c(O)cc(CCc4ccc(O)cc4)cc3OC(C)(C)C2CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.485
CB1 binding score: -16.83
InChIKey:PBEGVXRRRZSVOL-UHFFFAOYSA-N
ID: 126644
SMILES:CC1CC(O)C2c3c(O)cc(C)cc3OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -16.346
InChIKey:LLUSJGHSKZRTRO-UHFFFAOYSA-N
ID: 126645
SMILES:C(CCCCc1cc(O)c2c(c1)OC(C)(C)C1CC(O)C(C)=CC12)c1c(C)ccc(C(C)C)c1OBr
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 557.569
CB1 binding score: -17.194
InChIKey:MZWBUUNJKVBPQV-UHFFFAOYSA-N
ID: 126646
SMILES:C1(CC(O)=O)CCC2C(C)(C)Oc3cc(CCCCC)cc(c32)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -13.395
InChIKey:PBOFVOSKGMWPJU-UHFFFAOYSA-N
ID: 126647
SMILES:C(c1cc(C2CC(C)=CCCC2C(CCCC(C)C)C)c(O)cc1C)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.675
CB1 binding score: -15.56
InChIKey:QUFIHSQEVQKZMQ-UHFFFAOYSA-N
ID: 126648
SMILES:C1CCC(C)C(c2c(O)cc(CCCCC)cc2O)C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.474
CB1 binding score: -16.582
InChIKey:UYNHSSZWAIGRIY-UHFFFAOYSA-N
ID: 126649
SMILES:C(=O)(C1=CCC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1)OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -18.065
InChIKey:MYWNNBHNJDCHPP-UHFFFAOYSA-N
ID: 126650
SMILES:c1(C)cc2c(cc1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 126651
SMILES:C1C2C(C)(C)Oc3c(c(O)cc(C)c3)C(CC(C)=CC1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -15.541
InChIKey:PKOQFIHBPIFGHC-UHFFFAOYSA-N