ID: 35806
SMILES:c1(OC)c(O)c2c(cc1)OC(C)(C)C1CCC(O)(C)C(O)C21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 308.374
CB1 binding score: -16.502
InChIKey:PECYEYFSLUJMQV-UHFFFAOYSA-N
ID: 35807
SMILES:C(=C(C)C(CC=C(C)C)O)CCC(=CCc1c(O)cc(CCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -17.252
InChIKey:HHEQQNJZQWKWJV-UHFFFAOYSA-N
ID: 35808
SMILES:c1(OC)cc2c(cc1CCCCC)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.522
InChIKey:ZKEVJOWMGAJOFL-UHFFFAOYSA-N
ID: 35809
SMILES:C1(=O)C2(C)C3C(c4c(O)cc(CCCCC)cc4OC3CC1c1ccc(O)cc1)C1(OC(C)(C)C=C1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 504.623
CB1 binding score: -15.984
InChIKey:KJTCXNBKMZFMIA-UHFFFAOYSA-N
ID: 35810
SMILES:O1C2C3C4(C(OC(C)=O)C(OC(=O)C)C(C)C4(C)CC2c2c1cc(CCCCC)cc2O)OC3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.578
CB1 binding score: -15.453
InChIKey:ZSLMRSMGGDOEKN-UHFFFAOYSA-N
ID: 35811
SMILES:C(CC(=C)C)CC(C)=CCc1c(O)cc2c3c1OC(C)(C)C1C3C(C(C)(C)O2)CCC1(OC(=O)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 496.688
CB1 binding score: Not available
InChIKey:JIIJDAICXOQONN-UHFFFAOYSA-N
ID: 35812
SMILES:Oc1c2c(c(Cl)c(O)c1C(CC(C)C)=O)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.896
CB1 binding score: -18.054
InChIKey:JKIYARLJFFQVCC-UHFFFAOYSA-N
ID: 35813
SMILES:C1=C(C)CCC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.401
InChIKey:YTFIYQAKEHZACO-UHFFFAOYSA-N
ID: 35814
SMILES:O(C)C1OCC(COC(CC(C)C)=O)=C1CCC1(C)C=Cc2c(c(C)cc(OC)c2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.541
CB1 binding score: -15.395
InChIKey:WNIUVAXQCCQJCB-UHFFFAOYSA-N
ID: 35815
SMILES:Oc1c2c(cc(CCCCC)c1)OC1(C)CCC3C(C)(C1O2)C(O)CC1C(C)C(=O)OC13
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.568
CB1 binding score: -14.421
InChIKey:AAPRZHQAXPCVRB-UHFFFAOYSA-N
ID: 35816
SMILES:C(CC)=CCc1cc2c(c(O)c1)C1C(C(=C)C)CCC(C)(O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -16.109
InChIKey:ROCMCFVUPVWFPD-UHFFFAOYSA-N
ID: 35817
SMILES:C(C(=CCc1c(C(=O)O)c(O)c(CCCCC)cc1O)C)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.956
InChIKey:MCCRYOKICHTKLW-UHFFFAOYSA-N
ID: 35818
SMILES:Oc1c(C(=O)C(CC)C=C)c(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -15.383
InChIKey:VVSPRPVCWUKRSS-UHFFFAOYSA-N
ID: 35819
SMILES:C1(COC(=O)O)=CC2C(C=C1)C(C)(C)Oc1c(cc(CCCCC)cc1O)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -13.662
InChIKey:AYCREPWOWGWWPX-UHFFFAOYSA-N
ID: 35820
SMILES:CC12C(CC3(C)CC1c1c(O)c(C(=O)O)c(CCCCC)cc1O3)C(C)CCC2C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.624
CB1 binding score: -15.166
InChIKey:PTVOPKNGSMBKJD-UHFFFAOYSA-N
ID: 35821
SMILES:C(CC)CCCc1cc2c(c(O)c1)C1C(O)(C(C)(C)C2)C=C(C(=O)OC)CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.624
CB1 binding score: -13.821
InChIKey:CQCCNZLUWKXUQM-UHFFFAOYSA-N
ID: 35822
SMILES:O=C(OC1CC(C)(O)C2Oc3c(c(OC)cc(CCCCC)c3)C2C2C1C2(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -15.811
InChIKey:VUQQEHRUOVIGMA-UHFFFAOYSA-N
ID: 35823
SMILES:C1(C(C)C)C(c2c(O)cc(CCCCC)cc2)C(C(=C)C)CCC1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.567
CB1 binding score: -14.993
InChIKey:GGHNCTOKEIDQQQ-UHFFFAOYSA-N
ID: 35824
SMILES:C1(C)(C)Oc2c(c(O)c(C)c(OC)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -16.551
InChIKey:DRKREAPYJYJLSU-UHFFFAOYSA-N
ID: 35825
SMILES:c12c(OC)cc(CCCCC)cc1OC(CCC=C(C)C)(C)C1CC=C(C)C(=O)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.598
CB1 binding score: -15.055
InChIKey:WVNIDYIOROGREQ-UHFFFAOYSA-N
ID: 35826
SMILES:C(O)(C1=CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)CC1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N