ID: 23143
SMILES:CC1CC2C(CC3OCC3(O)CC1)C(C)(C)Oc1c2c(O)cc(CCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -15.476
InChIKey:XFVKSUUEKPVCLY-UHFFFAOYSA-N
ID: 23144
SMILES:C12(O)c3c(cc(CCCCC)cc3O)OC(C)(C)C1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.348
CB1 binding score: -16.117
InChIKey:HXLNWSOPPYPLCC-UHFFFAOYSA-N
ID: 23145
SMILES:C(C)CCCc1cc2c(c(O)c1)C1C(O)C(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.186
InChIKey:KQQMZTULVOWZJR-UHFFFAOYSA-N
ID: 23146
SMILES:C1CC(C)(CO)C2C(=O)C3(c4c(O)cc(CCCCC)cc4OC3(C)C)CC(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -14.435
InChIKey:ZPUCOLXXNQYINB-UHFFFAOYSA-N
ID: 23147
SMILES:C(CCCc1cc2c(c(O)c1)C1C(C(O)(C)C)CCC(C)(O2)C1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.538
CB1 binding score: -16.443
InChIKey:RQLRHIMSQLDAGN-UHFFFAOYSA-N
ID: 23148
SMILES:C1CC2C(C)(C)Oc3cc(CCCCC)ccc3C2C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.443
CB1 binding score: -15.172
InChIKey:QOKQRENVUSWLSD-UHFFFAOYSA-N
ID: 23149
SMILES:C=C(C)C1CCC(C)=CC1c1c(O)cc(CCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.739
InChIKey:WBRXESQKGXYDOL-UHFFFAOYSA-N
ID: 23150
SMILES:CCCC(C)(Oc1c2c(cc(C)c1)OC(C)CC2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.393
CB1 binding score: -13.402
InChIKey:IMISYIVGOVNNCC-UHFFFAOYSA-N
ID: 23151
SMILES:C1C2C(C)(C)Oc3c(c(OC)cc(CCCCC)c3)C2C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.348
InChIKey:FJRQDVCLUUZSIG-UHFFFAOYSA-N
ID: 23152
SMILES:c1c(OC(=O)C)c2c(c(O)c1)C1CC(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -17.279
InChIKey:BQEQVWFTJSOMMM-UHFFFAOYSA-N
ID: 23153
SMILES:O(c1cc(O)c(C(=O)CC2(C)C3CCC(C)=CC3CC(C)(C)C2)c(CCCCC)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.641
CB1 binding score: -16.446
InChIKey:SOVCILRULVHYIT-UHFFFAOYSA-N
ID: 23154
SMILES:C1(C(C)=C)C(c2c(O)cc(CCCC)cc2O)C=C(C)C(=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -18.369
InChIKey:YUWDHDPGZUPROY-UHFFFAOYSA-N
ID: 23155
SMILES:C1(C)=CC2C(C(C)(C)Oc3c2c(OC)cc(C(C)(C)C=C)c3O)CCC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -17.187
InChIKey:UHJUMQXQOBHTKG-UHFFFAOYSA-N
ID: 23156
SMILES:C1C=C(C)CCCC(C)=CC2C1C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -16.967
InChIKey:WOYOXVOVSDOOHO-UHFFFAOYSA-N
ID: 23157
SMILES:C1(C(C)=C)CCC(C)=CC1c1c(O)cc(CCC)c(C=O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -18.164
InChIKey:HQQHBAMOKHQOCQ-UHFFFAOYSA-N
ID: 23158
SMILES:C(C)CCCc1cc2c(c(O)c1)C1C3C2(C=CC1C(C)(O)C)CO3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -14.695
InChIKey:PDCNVYBJDJRAOT-UHFFFAOYSA-N
ID: 23159
SMILES:C12CC(=O)OC1(c1c(cc(CCCCC)cc1O)OC(C)(C)C1CC=C(C)C1)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.526
CB1 binding score: -12.287
InChIKey:KDGURVCTRVXHDJ-UHFFFAOYSA-N
ID: 23160
SMILES:C(=C(C)C)C1Oc2c3c(c(C4C(C(C)(C)O)CCC(C)=C4)ccc2=O)OC(C)(C)C13
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.554
CB1 binding score: Not available
InChIKey:UTXMCKZSCSXQPP-UHFFFAOYSA-N
ID: 23161
SMILES:C(CC=C(C)C)C(=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 23162
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C3(C)CCC4C(C)(C)C4C3C(O)(C1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -12.746
InChIKey:OJCTUNZUXHGKSX-UHFFFAOYSA-N
ID: 23163
SMILES:C12C(c3c(O)cc(CCCCC)c(C(=O)CC(C)C)c3O)OC(C)(C)C1CCC(O)(C)C2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.627
CB1 binding score: -16.015
InChIKey:VYOQIGKTQOLQIP-UHFFFAOYSA-N