ID: 35974
SMILES:C1(C(C)(C)O)Oc2cc(CCCCC)cc(O)c2C=C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -17.683
InChIKey:BZJPPSRZOYOQQD-UHFFFAOYSA-N
ID: 35975
SMILES:CC1=CC2C(C(C)(C)Oc3c(C(=O)C(C)C)cc(O)c(C)c23)CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -14.783
InChIKey:OEZILTSKGBXYIF-UHFFFAOYSA-N
ID: 35976
SMILES:c1(CCCO)cc(O)c(C2C=C(C)CCC2C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -16.058
InChIKey:UPAHTMZCKSBTTQ-UHFFFAOYSA-N
ID: 35977
SMILES:C(Cc1c(O)c2c(cc1C)OC(C)(C)C1CC=C(C)CC21)C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -12.76
InChIKey:FRRZCSKAPQKBNQ-UHFFFAOYSA-N
ID: 35978
SMILES:CCCCCc1cc(O)c2c(c1)OC(C)(C)C1=CC(=O)C(C)(O)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.502
InChIKey:GLSYAEMXTWVJQP-UHFFFAOYSA-N
ID: 35979
SMILES:C1=C(C)CCC2C(C)(C)Oc3c(c(O)cc(CCCC)c3)C2C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -14.504
InChIKey:ZFBLUVUCGSMQEC-UHFFFAOYSA-N
ID: 35980
SMILES:c12c(cc(CCCCC)cc1O)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: 35981
SMILES:C1C2(C(C)(C)Oc3cc(c(CCCCC)cc3O)O2)C=CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.289
InChIKey:CFLLAUFHHKCYQK-UHFFFAOYSA-N
ID: 35982
SMILES:c1(CCc2ccc(OC)c(O)c2)cc(OC)c2c(c1)OC(C)(C)C1C2CC(C)(O)C1CCC(O)(C)C=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 510.671
CB1 binding score: -15.29
InChIKey:PHOXDLKWKWISQR-UHFFFAOYSA-N
ID: 35983
SMILES:C(CCCCc1cc2c(c(O)c1)OC(C)(C)C1C2C(O)C=C(C)C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.296
InChIKey:CYYNSMCMQCFFGL-UHFFFAOYSA-N
ID: 35984
SMILES:C(C)CCCCc1cc2c(c(O)c1)C1C=C(C=O)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.687
InChIKey:WUKPITZIDDNGJC-UHFFFAOYSA-N
ID: 35985
SMILES:Oc1c(C2C=C(C)CCC2C(C)=C)c(O)ccc1OC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -18.273
InChIKey:QQKRWAQYJVGZFH-UHFFFAOYSA-N
ID: 35986
SMILES:C1(C)(C)Oc2cc(CCCCC)cc(O)c2OC1C(O)=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 294.347
CB1 binding score: -15.979
InChIKey:CZNRHYVXBWAEET-UHFFFAOYSA-N
ID: 35987
SMILES:C1(CC=C(C)C)CC2(CC(=O)OCC)CC(C(=C)C)CCC3=C1OC(C)(C)C2C3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -12.024
InChIKey:KSPHBBYRALQQJM-UHFFFAOYSA-N
ID: 35988
SMILES:O(C)c1c(OC)ccc(C=CC(=O)C)c1-c1cc(O)c2c(c1)OC(C)(C)C1CCC(COC(=O)C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 506.595
CB1 binding score: -14.134
InChIKey:HWKBXESKOUQNGJ-UHFFFAOYSA-N
ID: 35989
SMILES:C1(OC(C)=O)C(=C)CCC(C(C)C)C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -14.859
InChIKey:JSSQHYGIIDKYCX-UHFFFAOYSA-N
ID: 35990
SMILES:c1(O)c2c(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: 35991
SMILES:Oc1cc2c(cc1C)OC(C)(C)C1C2C=C(C(O)=O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Bisabolane sesquiterpenoids;Cannabinoids
MW: 288.343
CB1 binding score: -17.196
InChIKey:JQKMXCOKTFPPAA-UHFFFAOYSA-N
ID: 35992
SMILES:OCC1OC(Oc2c(CC=C(CCC=C(C)C)C)cc(CCCCC)cc2O)C(O)C(O)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 478.626
CB1 binding score: -16.585
InChIKey:SSGYJPPGEJAFPX-UHFFFAOYSA-N
ID: 35993
SMILES:CC1(C)C2(C(=O)Oc3ccc([N+](=O)O)cc3)CCC(C)=CC2c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.581
CB1 binding score: -15.199
InChIKey:BKKFEVGFEOMCHR-UHFFFAOYSA-O
ID: 35994
SMILES:C1C(C)C2=C(C3C(C(C)(C)OCC)Oc4c3c2cc(CCCC(C)C)c4)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -15.929
InChIKey:YAJJMQWFMRSYHN-UHFFFAOYSA-N