ID: 39607
SMILES:O(C(=O)C=C(C)C)c1c2c(c(C(=O)CC(C)C)c(O)c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.553
CB1 binding score: -16.606
InChIKey:VCIJIQJBMLLKHJ-UHFFFAOYSA-N
ID: 39608
SMILES:O=C1C(C(=O)C(CC)C)=C(O)C2C=C(C)CCC2C(C)(C)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.402
CB1 binding score: -16.1
InChIKey:LUNYQSNIDPLGIN-UHFFFAOYSA-N
ID: 39609
SMILES:C1CC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 39610
SMILES:C(CC(c1c(O)c(Br)c2c(c1)OC(C)(C)C1CCC(CO)=CC12)=O)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 449.385
CB1 binding score: -15.769
InChIKey:JDNPEADCNYJKRQ-UHFFFAOYSA-N
ID: 39611
SMILES:O=C(O)c1c(CCCCC)cc2c(c1O)C1CC(C)(CCC1C(=C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.502
InChIKey:QQKHMQAUINFKKL-UHFFFAOYSA-N
ID: 39612
SMILES:c1(-c2c(O)cc(CCCC)cc2O)c(O)c2c(c(O)c1)C1C(C(=C)C)CCC1(C)OC2=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.52
CB1 binding score: -16.502
InChIKey:HCQJMODMAGZWJK-UHFFFAOYSA-N
ID: 39613
SMILES:C(=C(C)COC(C)=O)CCC(C)C1(O)CC(c2c(O)cc(CCCCC)cc2O)C(=O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.556
CB1 binding score: -16.269
InChIKey:LSLJPPCVELTZEP-UHFFFAOYSA-N
ID: 39614
SMILES:C1C(C(C)C)C(c2c(O)cc(CCCC)cc2OC)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.407
InChIKey:SMMGTDCVIQYVOD-UHFFFAOYSA-N
ID: 39615
SMILES:c12c(cc(CC=C)cc1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -18.166
InChIKey:FGEQAFJXCIBXCD-UHFFFAOYSA-N
ID: 39616
SMILES:CC1(C)C2C(C=C(C)C(=O)C2)c2c(OC(=O)C)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -17.106
InChIKey:QYHVVVWLUBURBV-UHFFFAOYSA-N
ID: 39617
SMILES:C(CC(C1(O)C(O)C(C(C)(O)C)CC1)C)CC(=CCc1c(O)c(C)cc(O)c1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.563
CB1 binding score: -13.606
InChIKey:RPNTXZJFIZXLFV-UHFFFAOYSA-N
ID: 39618
SMILES:C(c1c(CCC)cc2c(c1O)C1CC(C)CCC1C(C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -14.587
InChIKey:GMCOPOGKWKKRFX-UHFFFAOYSA-N
ID: 39619
SMILES:C1(C(=C)C)C2C(C)(CC3C(CC3c3c(O)cc(CCCCC)cc3O2)C(C)(O)CC1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.641
CB1 binding score: -15.065
InChIKey:LNTXWKIAQRQKOZ-UHFFFAOYSA-N
ID: 39620
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -19.729
InChIKey:GIIVGKMZIUKMMN-UHFFFAOYSA-N
ID: 39621
SMILES:C1(C(C)=C)C2c3c(cc(CCCCC)c(C(O)=O)c3O)OC(C)(C)C3C2C=C(CCC=C(C)CC1)C(=O)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 522.682
CB1 binding score: -14.051
InChIKey:HHEVGAJVMRJGLZ-UHFFFAOYSA-N
ID: 39622
SMILES:Oc1cc(CCCC)c2c(c1-c1cc(O)c(CC=C(C)CCC=C(C)C)c(O)c1)OC(C)CC2O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.645
CB1 binding score: -14.338
InChIKey:YNMWSRRUYWIKBT-UHFFFAOYSA-N
ID: 39623
SMILES:CCCCCc1cc2c(cc1O)C=CC(CCC=C(C)CO)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.695
InChIKey:RUOJZPSLWGKJSC-UHFFFAOYSA-N
ID: 39624
SMILES:C1(C=O)=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -19.053
InChIKey:HQRKNUDGMPVIMO-UHFFFAOYSA-N
ID: 39625
SMILES:C1c2c(cc(CCCCC)cc2O)OC(C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -19.22
InChIKey:AHKIGVNVQSVNEP-UHFFFAOYSA-N
ID: 39626
SMILES:C(CC)CCc1cc2c(cc1O)OC1(C)C(C2)C(C)=CC(O)C(C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -13.73
InChIKey:YWOTXMSBHLYLGV-UHFFFAOYSA-N
ID: 39627
SMILES:CC1=CC2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N