ID: 81103
SMILES:C(CC(c1c(O)cc(CCCCC)cc1O)O)C=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.538
CB1 binding score: -15.717
InChIKey:XTPAUSLVZYUUOM-UHFFFAOYSA-N
ID: 81104
SMILES:CC1(CC(C(=C)C)=O)Oc2c3c(cc(CCCCC)c2)OC(C)(C)C2C1C=C(C)C2C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.609
CB1 binding score: -14.502
InChIKey:ZHGNQBFBAJYMQM-UHFFFAOYSA-N
ID: 81105
SMILES:C(C1=CC2C(C(C)(C)Oc3cc(CCc4ccccc4)cc(O)c32)CC1)=O
Pathway: Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids;Stilbenoids
Class: Cannabinoids;Monomeric stilbenes
MW: 362.469
CB1 binding score: -15.893
InChIKey:OSMLNEPJPZNLQH-UHFFFAOYSA-N
ID: 81106
SMILES:C1(Cl)C(C)(C)Oc2cc(CCCCC)cc(O)c2C1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.794
CB1 binding score: -16.461
InChIKey:YUVYIZRPMMXPRI-UHFFFAOYSA-N
ID: 81107
SMILES:COCc1cc(O)c2c(c1CC(C)=O)C(C1C(C)(C)Oc3c1ccc(C)c3CCC=C(C)C)(C(=O)OC)Oc1cccc(c1)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 626.79
CB1 binding score: -13.861
InChIKey:XPJSOROTLXJVCY-UHFFFAOYSA-N
ID: 81108
SMILES:O(c1c(CCCCC)cc(O)c2c1OC1(O2)CC=C(CCC=C(C)C)CC1C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -16.561
InChIKey:LLAAMEKLUBZBHX-UHFFFAOYSA-N
ID: 81109
SMILES:CC12Oc3cc(CCCCCC)cc(O)c3-C1Cc1c(c(O)ccc1O)C2=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.456
CB1 binding score: -15.083
InChIKey:JCLUVHJVMIRMNK-UHFFFAOYSA-N
ID: 81110
SMILES:C1(C)(O)CCC2C(C)(C)Oc3cc(CCc4ccccc4)c(O)c(C(=O)CCC)c3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.592
CB1 binding score: -12.614
InChIKey:CTOVOYWBEPECBB-UHFFFAOYSA-N
ID: 81111
SMILES:c1(CCCCC)c(C2C(C(C)=C)CCC3(C)OOC32)c(O)ccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.29
InChIKey:VTBAFYJZEMUXLF-UHFFFAOYSA-N
ID: 81112
SMILES:C(Cc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.609
InChIKey:HAKUWGCTBUVNJQ-UHFFFAOYSA-N
ID: 81113
SMILES:O1CC1=Cc1c(CCCCC)cc2c(c1O)CC(O)C(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -15.929
InChIKey:JWXYQIPGHALSMP-UHFFFAOYSA-N
ID: 81114
SMILES:O(C)c1cc(CCCCC)cc2c1C1C(C(C)(O)CCC1C(C)(C)O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -17.052
InChIKey:PAUOSJLOPITKHM-UHFFFAOYSA-N
ID: 81115
SMILES:c1(O)cc(CCCCC)ccc1C1C=C(C)CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.957
InChIKey:OANGEIYPAQYPQV-UHFFFAOYSA-N
ID: 81116
SMILES:c1c(O)c2c(cc1C)OC(CC(CCC(C)=CCO)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -15.263
InChIKey:HSGOGXFXNWOQSX-UHFFFAOYSA-N
ID: 81117
SMILES:CCCCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CC=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.821
InChIKey:CUWJKLPAOPPJHN-UHFFFAOYSA-N
ID: 81118
SMILES:C(=O)c1cc2c(cc1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.42
CB1 binding score: -18.45
InChIKey:HXZOLVRQLAQLGI-UHFFFAOYSA-N
ID: 81119
SMILES:CC(=CCCC1(C)C=Cc2cc(O)ccc2O1)CCC1C(C)(C)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -18.509
InChIKey:XTVFMVOKSWJIQO-UHFFFAOYSA-N
ID: 81120
SMILES:Oc1cc(CCc2cc(O)cc(O)c2)cc2c1C1C(CCC(CO)=C1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.483
CB1 binding score: -13.893
InChIKey:LDVIOEZDRDEDOA-UHFFFAOYSA-N
ID: 81121
SMILES:CCCCCc1cc2c(c(O)c1)C1C=C(C(=O)OC)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.943
InChIKey:CCMWHLPOQSRJEP-UHFFFAOYSA-N
ID: 81122
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 81123
SMILES:CC(=O)Oc1c(C(C(C)CC)=O)c(OC)c2c(c1OC)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.541
CB1 binding score: -12.066
InChIKey:VNPQFFQSHWOXHG-UHFFFAOYSA-N