ID: 48826
SMILES:C1C(C)=CCCC(C)=CC=C(C(C)(C)Oc2ccc(CCCCC)cc2O)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -14.571
InChIKey:MKCQPJITWTWKPJ-UHFFFAOYSA-N
ID: 48827
SMILES:C(C(=C)C(C)C)CC(C)=CCc1c(O)c(C(=O)O)c(CCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.658
InChIKey:CESVTNMBFVUBRP-UHFFFAOYSA-N
ID: 48828
SMILES:C(COc1c(O)c(C(=O)OC)cc(CCCCC)c1)=C(CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -16.998
InChIKey:FMYRKHGZTAURCL-UHFFFAOYSA-N
ID: 48829
SMILES:CC(=O)OC1(C)CC2C(C(C)(C)Oc3cc4c(c(CCCC)c3C)CCC(C)C4C2)C=C1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.651
CB1 binding score: -14.856
InChIKey:FCFCYATXQJXWFP-UHFFFAOYSA-N
ID: 48830
SMILES:c1(OC)c(CCCCC)c2c(c(C=O)c1O)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.063
InChIKey:HUTOIEHVQVSLMX-UHFFFAOYSA-N
ID: 48831
SMILES:C12C(c3c(cc(CCCCCO)cc3O)OC1C=C(C)C)CCC2(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -14.423
InChIKey:AAPNRZVOHYGHQH-UHFFFAOYSA-N
ID: 48832
SMILES:c12c(C(C)(CCCC)C)cc(O)c(C)c1OC(C)(C)C1CCC(C)=C1C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -14.783
InChIKey:TWTUGPFPQVIOMZ-UHFFFAOYSA-N
ID: 48833
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1=CC3C(C)(CC(=O)CC3(O)C)CCC21C)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.624
CB1 binding score: -17.746
InChIKey:XVUUDTPURYCCKU-UHFFFAOYSA-N
ID: 48834
SMILES:C(C)CCCc1cc(O)c2c(c1)OC(C)(C)C1C2CC1(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -16.566
InChIKey:PRJBLSGLSVWJMY-UHFFFAOYSA-N
ID: 48835
SMILES:COc1cc(CCCC)c2c(c1)OC(CCC=C(CCC=C(C)C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -16.363
InChIKey:OCFNZANALFDOHE-UHFFFAOYSA-N
ID: 48836
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2(O)C=C3C(=C[CH]C4C(C)(C)CCCC43C)C1(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 435.628
CB1 binding score: -9.766
InChIKey:LSUYNVXXLZNABY-UHFFFAOYSA-N
ID: 48837
SMILES:c1c(CCCCC)cc2c(c1O)CC1C(C)(O2)CCC(C(C)(O)C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -15.732
InChIKey:SNLWQEOGBVQFHE-UHFFFAOYSA-N
ID: 48838
SMILES:COc1c(CC=C(C)C)c(O)cc(C)c1C1C=C(C)CCC1C(C)(O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.922
InChIKey:JTDYKADOTZXCHO-UHFFFAOYSA-N
ID: 48839
SMILES:C1(C)=CC(c2c(O)cc(O)c3c2OC(CO)(C)C(O)C3)C(CC=CC=CC(=O)O)(C)C2CCC(C)=CC21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 510.627
CB1 binding score: -16.481
InChIKey:NMBQSJCJVJJNSN-UHFFFAOYSA-N
ID: 48840
SMILES:c1c(CCCC)cc(O)c(C2C=C(CCCC(C)=C)CCC2(O)C(C)C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -14.635
InChIKey:GPDCCCKLPBOARO-UHFFFAOYSA-N
ID: 48841
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1)(C1(CO)CO1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.915
InChIKey:NIKUXSBKJJCOBC-UHFFFAOYSA-N
ID: 48842
SMILES:CC(C)C1CCC(C)=CC1c1c(O)cc(CC=C(C)CCC=C(C)C)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -16.148
InChIKey:KVLOTQUKBMKTIL-UHFFFAOYSA-N
ID: 48843
SMILES:C12C(=O)c3c(O)cc(CCCC)cc3OC1(C)CCC(C(=C)C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -14.5
InChIKey:AMVPCSBQOCIGHE-UHFFFAOYSA-N
ID: 48844
SMILES:C1(CCC=C(C)C)(C)Oc2c(c(O)cc(CCCCC)c2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.791
InChIKey:ORKZJYDOERTGKY-UHFFFAOYSA-N
ID: 48845
SMILES:C(CCCCC)Cc1cc2c(c(O)c1)C1CC(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.539
CB1 binding score: -17.402
InChIKey:USZILQYXSONCHH-UHFFFAOYSA-N
ID: 48846
SMILES:c1cc(CC=O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 270.372
CB1 binding score: -8.44
InChIKey:YZLZZFPBIQJXTO-UHFFFAOYSA-N