ID: 20350
SMILES:c1c2c(cc(CCCCC)c1)OC(CCC=C(CC(=O)C=C(C)C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -15.881
InChIKey:NQKBDSAIZAPUEK-UHFFFAOYSA-N
ID: 20351
SMILES:O=C1c2c(O)cc(CCCCC)cc2OC(C)(C)C(O)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.375
CB1 binding score: -16.7
InChIKey:AYBQUQJLBIGMML-UHFFFAOYSA-N
ID: 20352
SMILES:C(=Cc1ccccc1)C(CCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)CC1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.566
CB1 binding score: -15.956
InChIKey:MXTJXRRGRSGURF-UHFFFAOYSA-N
ID: 20353
SMILES:C(C)c1cc2c(c(O)c1)C1C(CCC(CO)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -17.316
InChIKey:HUIAWGFJOOMUSP-UHFFFAOYSA-N
ID: 20354
SMILES:c1(OC)cc(CCCCC)cc2c1C1C(C(C)(C)O2)CC=C(C)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.027
InChIKey:BJDDEBBYIXPOTQ-UHFFFAOYSA-N
ID: 20355
SMILES:C1(CC=C(C)CCC=C(C)C)CC(C)=CCc2c(O)cc(C)cc2O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: Not available
InChIKey:HYFKBJVWPWROIZ-UHFFFAOYSA-N
ID: 20356
SMILES:c1(O)c2c(c(CCC(C(C(O)C=C(C)C)O)C)cc1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -14.082
InChIKey:AXFAQVLJUREEGY-UHFFFAOYSA-N
ID: 20357
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C2c2c(cc(C)cc2O)C(C)(C)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.474
CB1 binding score: -13.69
InChIKey:RSAAKGLPAKFTJE-UHFFFAOYSA-N
ID: 20358
SMILES:c1(OC(=O)C)cc(CCCCC)cc2c1C1C(C(C)(C)O2)OC(C)(CCC=C(C)C)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.639
CB1 binding score: -16.259
InChIKey:BKMCOTPUDBNCOF-UHFFFAOYSA-N
ID: 20359
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -17.994
InChIKey:RSHHRAXMOZULOO-UHFFFAOYSA-N
ID: 20360
SMILES:C1(C)=CC=C(C(C)=C)CC(OC(=O)C)C2(C)Oc3c(c(O)cc(CCCCC)c3)C(O)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.634
CB1 binding score: -15.916
InChIKey:SYDQSZPEXVQPLZ-UHFFFAOYSA-N
ID: 20361
SMILES:C(C1=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)c(O)cc12)CC=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.707
CB1 binding score: -14.876
InChIKey:ZWPJMSGNIITBQF-UHFFFAOYSA-N
ID: 20362
SMILES:c1(C(O)C(O)(C)C)c2c(cc(CCCCC)c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -13.361
InChIKey:MEXLHCAOPLKRNX-UHFFFAOYSA-N
ID: 20363
SMILES:C1C(C)(C)C2C(c3c(cc(CCCCC)cc3O)O1)C=C(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.037
InChIKey:GARZVDDZIWZZEY-UHFFFAOYSA-N
ID: 20364
SMILES:C1CC2C(=Cc3c(O)c(C(=O)OC)c(CCCCC)cc3O1)C(O)C(O)(CCC(=C)C)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 488.621
CB1 binding score: -13.002
InChIKey:ZGXLTZAGCJUMDO-UHFFFAOYSA-N
ID: 20365
SMILES:C12C(C)(C)Oc3cc(CCCC)cc(O)c3C1CC(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.175
InChIKey:RVWTXSLOGRTPEH-UHFFFAOYSA-N
ID: 20366
SMILES:C12(c3c(O)cc(C)cc3OC1(C)C)C(C)(C(=O)C2)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -14.643
InChIKey:PGCOROAOTJFWIN-UHFFFAOYSA-N
ID: 20367
SMILES:C1=CC2C(C)(C)Oc3c(c(O)cc(CCCC)c3)C2CC1(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.813
InChIKey:PWXRETMDAHYTOA-UHFFFAOYSA-N
ID: 20368
SMILES:O(C)c1c(O)c(O)c(C=O)c2c1c1c(cc2C)OC(C)(C)C2C1CC(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.472
CB1 binding score: -15.158
InChIKey:KMNVXFBQYWPPKB-UHFFFAOYSA-N
ID: 20369
SMILES:C(C)CCCc1cc(O)c(C2C(C(C)C)CCC(C)=C2)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -18.957
InChIKey:XFYKOYWZVVGAEV-UHFFFAOYSA-N
ID: 20370
SMILES:C1C(CCC(C)(C)c2cc(O)c(O)cc2)=CCCC1C(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -12.77
InChIKey:YAQJPQUHUGTBGU-UHFFFAOYSA-N