ID: 46894
SMILES:Oc1cc(CCCCC)cc2c1OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.438
InChIKey:NKPBIUKTNLMNFS-UHFFFAOYSA-N
ID: 46895
SMILES:O(C(c1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)C1)=O)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -16.608
InChIKey:SKPYDHQLJLLNRK-UHFFFAOYSA-N
ID: 46896
SMILES:C1CC=C(C)CC1c1c(O)c(OC)ccc1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -14.059
InChIKey:UIHXGCPXKFQAHD-UHFFFAOYSA-N
ID: 46897
SMILES:C1=C(C(C)C)C2c3c(cc(CCCCC)cc3O)OC(C(C)C1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -13.683
InChIKey:PKICFCPYEGJXKZ-UHFFFAOYSA-N
ID: 46898
SMILES:C(C(C)=CCCC1(C)Oc2cc(CCCC(O)C)cc(O)c2C=C1)CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -14.914
InChIKey:VSLLUEYIVWPVMJ-UHFFFAOYSA-N
ID: 46899
SMILES:C(C)Cc1cc(O)c2c(c1)C1C(C(C)(C)O2)CCC(CO)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -15.802
InChIKey:ZCTGEGHKXZAITA-UHFFFAOYSA-N
ID: 46900
SMILES:C1(C)(C)C2CCC(C)=CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 46901
SMILES:Cc1c2c(ccc1)C1(c3c(cc(CCCCC)cc3O)OC1(C)C)CC=C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.567
CB1 binding score: -13.271
InChIKey:XYTNSCWICXFKFA-UHFFFAOYSA-N
ID: 46902
SMILES:C12(C)Oc3c(c(O)cc(CCCCCC)c3)C3OC(C)(C)C3CC1(OC)C(O)=C(C)C2=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.568
CB1 binding score: -14.542
InChIKey:VEQWDBFBSRUQHC-UHFFFAOYSA-N
ID: 46903
SMILES:CC(=O)CCC1C(C)(C)Oc2cc(CCCCC)c(C(=O)O)c(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.439
CB1 binding score: -17.706
InChIKey:VVOHWNMWGVKHEK-UHFFFAOYSA-N
ID: 46904
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: 46905
SMILES:C1=C(C)COC1c1c2c(c(C)cc1O)OC(C)(C)C(Cl)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 308.805
CB1 binding score: -16.736
InChIKey:DHYRQFOOJPRMEV-UHFFFAOYSA-N
ID: 46906
SMILES:C1(C)=CCCC=C(C)CCC(Cc2c(O)cc(CCc3ccccc3)cc2OC)C1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.648
CB1 binding score: -15.12
InChIKey:ARLGBCKLLLYBPE-UHFFFAOYSA-N
ID: 46907
SMILES:C(O)C(O)C(CCc1cc(O)c(C2C(C(C)=C)CC=C(C)C2)c(O)c1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -15.647
InChIKey:YKVMETNTIFGBSF-UHFFFAOYSA-N
ID: 46908
SMILES:CC(=CCCC(=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 46909
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(CCC=C(C)C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.002
InChIKey:ITDDKOGKAGSKEJ-UHFFFAOYSA-N
ID: 46910
SMILES:C1C(C)(CCC=C(C)C)c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -16.362
InChIKey:HGWNTYJPNNGQAG-UHFFFAOYSA-N
ID: 46911
SMILES:C1(=O)OC(C(C)CCCC(=CCc2c(O)cc(C)cc2O)C)CC=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.684
InChIKey:SPOJIEAGBIPUIA-UHFFFAOYSA-N
ID: 46912
SMILES:CC1(C(O)COC(CC(=O)OCC)=O)C=C2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 488.621
CB1 binding score: -15.218
InChIKey:BENIAMIDTHQTSN-UHFFFAOYSA-N
ID: 46913
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 46914
SMILES:CC1=CCCC2(C)CCC3C(C)(C)Oc4c(c(O)c(C(=O)CC(C)C)cc4O)C3C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -14.655
InChIKey:SKCHXCGRFJWLQY-UHFFFAOYSA-N