ID: 73711
SMILES:BrC1C(C)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 313.235
CB1 binding score: -14.927
InChIKey:CUWANVNXSGNBRZ-UHFFFAOYSA-N
ID: 73712
SMILES:CCC(C(C)C)(c1c(O)c2c(c(O)c1)C1C(C(COC(CCCCCCCCCCCCC)=O)(C)O2)CCC(C)=C1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 584.882
CB1 binding score: Not available
InChIKey:JNDBSACVEFSNMD-UHFFFAOYSA-N
ID: 73713
SMILES:C1(C)CC=C(C(C)C)C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -16.582
InChIKey:BLKUCBUYNAPOLI-UHFFFAOYSA-N
ID: 73714
SMILES:Oc1c2c(cc(CCCCC)c1)OC(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: 73715
SMILES:c1(O)cc(CCCCC)cc2c1-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 73716
SMILES:C1CC2C(C)(C)Oc3cc(CCCCC)c(Br)c(O)c3C2C=C1C(=O)OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 437.374
CB1 binding score: -15.526
InChIKey:BQEUBJLQPOUPBX-UHFFFAOYSA-N
ID: 73717
SMILES:C(CCCCC)=Cc1c(O)c2c(c(O)c1OC)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -14.821
InChIKey:VWABONZTHPULNX-UHFFFAOYSA-N
ID: 73718
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 73719
SMILES:c12cc(CCCCC)ccc1OC(CCC=C(C)C)(C)C(Cl)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.931
CB1 binding score: -16.76
InChIKey:FPGABNFATYTRRE-UHFFFAOYSA-N
ID: 73720
SMILES:C(NC(=O)Oc1cc(C)c(C(=O)OC)c(CCCCC)c1)C=C(CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 415.574
CB1 binding score: -15.526
InChIKey:IQDLJTSXCYIWMR-UHFFFAOYSA-N
ID: 73721
SMILES:c1c(C2CC(O)C(C)(C)OC3=C(CCC(C)C(OC)=O)C(O)C(=O)C32C)c(O)c(CCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 504.62
CB1 binding score: -15.379
InChIKey:JOQAKGYREANISR-UHFFFAOYSA-N
ID: 73722
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 73723
SMILES:C1(=C)C2CC(c3c(O)cc(CCC)cc3OC2(C)C)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -16.522
InChIKey:HMMQAQVGMCDYQV-UHFFFAOYSA-N
ID: 73724
SMILES:O=C1OCC2(C)C3C1=COC3C1OCC23Oc2cc(CCCCC)cc(O)c2C3=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.466
CB1 binding score: -15.679
InChIKey:UZXRRCYQDWUTEN-UHFFFAOYSA-N
ID: 73725
SMILES:C1CC2(C)OC1c1c(cc(CCCCC)c(C(O)=O)c1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.439
CB1 binding score: -13.485
InChIKey:CSQSOTGYYDLGIB-UHFFFAOYSA-N
ID: 73726
SMILES:C1(C(=C)C)CC=C(C)CC1c1c(O)cc(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -18.748
InChIKey:ORIYPICUSOGUOA-UHFFFAOYSA-N
ID: 73727
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C(O)=O)CC1)C1C(C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -15.775
InChIKey:UQHIMIAFGXRGSO-UHFFFAOYSA-N
ID: 73728
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1(OC(C)(C=CC(=O)OC)CC1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -14.24
InChIKey:SOBNMZWGHWXBER-UHFFFAOYSA-N
ID: 73729
SMILES:OCC1=CC2C(CC1Cl)C(C)(C)Oc1c2cc(O)c(CC=C(C)CCC=C(C)C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 447.015
CB1 binding score: -16.631
InChIKey:HTDNUNFBAFWTGN-UHFFFAOYSA-N
ID: 73730
SMILES:CC1=CC2C(C(C)(C)Oc3c2c(O)ccc3)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -19.281
InChIKey:KZTIITBECKQIPO-UHFFFAOYSA-N
ID: 73731
SMILES:C1C(CCOC(C=Cc2ccc(OC)cc2)=O)c2c(O)cc(CCCCC)cc2OC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.591
CB1 binding score: -15.38
InChIKey:LVCIBSRQDFHBEY-UHFFFAOYSA-N